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1-docosanoyl-2-tridecanoyl-3-(10Z,13Z,16Z-docosatrienoyl)-sn-glycerol

PropertiesImage
MNX_IDMNXM349324 Image of MNXM349324
referenceslm:000204394
formulaC60H110O6
global charge0
mol weight927.534
InChIKeyFUULOASMWQENRQ-LNURWKRGSA-N
InChIInChI=1S/C60H110O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-41-43-46-49-52-58(61)64-55-57(66-60(63)54-51-48-45-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-42-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h16,19,24,26,30,32,57H,4-15,17-18,20-23,25,27-29,31,33-56H2,1-3H3/b19-16-,26-24-,32-30-/t57-/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C60H110O6/c1-4-7-10-13-16-19-22-24-26-28-30-32-34-36-38-41-43-46-49-52-58(61)64-55-57(66-60(63)54-51-48-45-40-21-18-15-12-9-6-3)56-65-59(62)53-50-47-44-42-39-37-35-33-31-29-27-25-23-20-17-14-11-8-5-2/h16,19,24,26,30,32,57H,4-15,17-18,20-23,25,27-29,31,33-56H2,1-3H3/b19-16-,26-24-,32-30-/t57-/m0/s1 Image of MNXM349324
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:32]\[CH2:34][CH2:36][CH2:38][CH2:41][CH2:43][CH2:46][CH2:49][CH2:52][C:58](=[O:61])[O:64][CH2:55][C@@H:57]([CH2:56][O:65][C:59]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:42][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:62])[O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:40][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:63]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000204394
slm:000204394
FUULOASMWQENRQ-LNURWKRGSA-N
1-docosanoyl-2-tridecanoyl-3-(10Z,13Z,16Z-docosatrienoyl)-sn-glycerol
TG(22:0/13:0/22:3(10Z,13Z,16Z))
Triacylglycerol (22:0/13:0/22:3(10Z,13Z,16Z))